N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide

C16H14N4O — CID 119063696

IUPACN,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide
SMILESCN(C)C(=O)c1cncc(-c2cccc3ncccc23)n1
InChIInChI=1S/C16H14N4O/c1-20(2)16(21)15-10-17-9-14(19-15)12-5-3-7-13-11(12)6-4-8-18-13/h3-10H,1-2H3
InChIKeyYFZXHISDIGDRKO-UHFFFAOYSA-N
MW278.32 g/mol
LogP2.39
Rot. Bonds2

About N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide

N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide (PubChem CID 119063696) has the molecular formula C16H14N4O and a molecular weight of 278.32 g/mol. Its IUPAC name is N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide
PubChem CID119063696
Molecular FormulaC16H14N4O
Molecular Weight278.32 g/mol
Exact Mass278.12
IUPAC NameN,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide
SMILESCN(C)C(=O)c1cncc(-c2cccc3ncccc23)n1
InChIInChI=1S/C16H14N4O/c1-20(2)16(21)15-10-17-9-14(19-15)12-5-3-7-13-11(12)6-4-8-18-13/h3-10H,1-2H3
InChIKeyYFZXHISDIGDRKO-UHFFFAOYSA-N
XLogP2.39
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide?
The IUPAC name of N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide (CID 119063696) is N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide is CN(C)C(=O)c1cncc(-c2cccc3ncccc23)n1.
What is the InChIKey of N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide?
The InChIKey is YFZXHISDIGDRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O/c1-20(2)16(21)15-10-17-9-14(19-15)12-5-3-7-13-11(12)6-4-8-18-13/h3-10H,1-2H3.
What are the key properties of N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide?
N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide has a molecular weight of 278.32 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-quinolin-5-ylpyrazine-2-carboxamide is sourced from PubChem (CID 119063696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).